NMR Restraints Grid
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NMR Restraints Grid |
|
Result table
| image | mrblock_id | pdb_id | bmrb_id | cing | stage | position | program | type |
|
|
2179 |
1bhu   |
4217 | cing | 1-original | 5 | XPLOR/CNS | dihedral angle |
! angle restraints
!
! 1997.05.13 Shin-ichi Tate
!! phi torsion constraints
!! CYSS4
assign (resid 3 and name c ) (resid 4 and name n )
(resid 4 and name ca) (resid 4 and name c ) 1.0 -65.0 25.0 2
!! S8
assign (resid 7 and name c ) (resid 8 and name n )
(resid 8 and name ca) (resid 8 and name c ) 1.0 -120.0 40.0 2
!! CYSS10
assign (resid 9 and name c ) (resid 10 and name n )
(resid 10 and name ca) (resid 10 and name c ) 1.0 -65.0 25.0 2
!! T11
assign (resid 10 and name c ) (resid 11 and name n )
(resid 11 and name ca) (resid 11 and name c ) 1.0 -120.0 50.0 2 !
!! Y12
assign (resid 11 and name c ) (resid 12 and name n )
(resid 12 and name ca) (resid 12 and name c ) 1.0 -120.0 40.0 2
!! S18
assign (resid 17 and name c ) (resid 18 and name n )
(resid 18 and name ca) (resid 18 and name c ) 1.0 -120.0 40.0 2
!! R21
assign (resid 20 and name c ) (resid 21 and name n )
(resid 21 and name ca) (resid 21 and name c ) 1.0 -65.0 25.0 2
!! T22
assign (resid 21 and name c ) (resid 22 and name n )
(resid 22 and name ca) (resid 22 and name c ) 1.0 -120.0 40.0 2
!! I24
assign (resid 23 and name c ) (resid 24 and name n )
(resid 24 and name ca) (resid 24 and name c ) 1.0 -120.0 40.0 2
!! D28
assign (resid 27 and name c ) (resid 28 and name n )
(resid 28 and name ca) (resid 28 and name c ) 1.0 -65.0 25.0 2
!! K31
assign (resid 30 and name c ) (resid 31 and name n )
(resid 31 and name ca) (resid 31 and name c ) 1.0 -65.0 25.0 2
!! V37
assign (resid 36 and name c ) (resid 37 and name n )
(resid 37 and name ca) (resid 37 and name c ) 1.0 -120.0 40.0 2
!! L39
assign (resid 38 and name c ) (resid 39 and name n )
(resid 39 and name ca) (resid 39 and name c ) 1.0 -120.0 40.0 2 !
!! S42
assign (resid 41 and name c ) (resid 42 and name n )
(resid 42 and name ca) (resid 42 and name c ) 1.0 -65.0 35.0 2 !
!! A47
assign (resid 46 and name c ) (resid 47 and name n )
(resid 47 and name ca) (resid 47 and name c ) 1.0 -120.0 40.0 2
!! G49
assign (resid 48 and name c ) (resid 49 and name n )
(resid 49 and name ca) (resid 49 and name c ) 1.0 -65.0 25.0 2
!! F52
assign (resid 51 and name c ) (resid 52 and name n )
(resid 52 and name ca) (resid 52 and name c ) 1.0 -65.0 45.0 2 !
!! L54
assign (resid 53 and name c ) (resid 54 and name n )
(resid 54 and name ca) (resid 54 and name c ) 1.0 -120.0 40.0 2
!! R55
assign (resid 54 and name c ) (resid 55 and name n )
(resid 55 and name ca) (resid 55 and name c ) 1.0 -120.0 50.0 2 !
!! V62
assign (resid 61 and name c ) (resid 62 and name n )
(resid 62 and name ca) (resid 62 and name c ) 1.0 -120.0 40.0 2
!! T63
assign (resid 62 and name c ) (resid 63 and name n )
(resid 63 and name ca) (resid 63 and name c ) 1.0 -120.0 40.0 2
!! CYSS64
assign (resid 63 and name c ) (resid 64 and name n )
(resid 64 and name ca) (resid 64 and name c ) 1.0 -120.0 40.0 2
!! V65
assign (resid 64 and name c ) (resid 65 and name n )
(resid 65 and name ca) (resid 65 and name c ) 1.0 -120.0 40.0 2
!! CYSS69
assign (resid 68 and name c ) (resid 69 and name n )
(resid 69 and name ca) (resid 69 and name c ) 1.0 -120.0 40.0 2
!! Y70
assign (resid 69 and name c ) (resid 70 and name n )
(resid 70 and name ca) (resid 70 and name c ) 1.0 -65.0 25.0 2
!! A73
assign (resid 72 and name c ) (resid 73 and name n )
(resid 73 and name ca) (resid 73 and name c ) 1.0 -120.0 40.0 2
!! V75
assign (resid 74 and name c ) (resid 75 and name n )
(resid 75 and name ca) (resid 75 and name c ) 1.0 -120.0 40.0 2
!! K77
assign (resid 76 and name c ) (resid 77 and name n )
(resid 77 and name ca) (resid 77 and name c ) 1.0 -120.0 40.0 2
!! V78
assign (resid 77 and name c ) (resid 78 and name n )
(resid 78 and name ca) (resid 78 and name c ) 1.0 -120.0 40.0 2
!! A79
assign (resid 78 and name c ) (resid 79 and name n )
(resid 79 and name ca) (resid 79 and name c ) 1.0 -65.0 25.0 2
!! L84
assign (resid 83 and name c ) (resid 84 and name n )
(resid 84 and name ca) (resid 84 and name c ) 1.0 -120.0 40.0 2
!! R85
assign (resid 84 and name c ) (resid 85 and name n )
(resid 85 and name ca) (resid 85 and name c ) 1.0 -65.0 40.0 2 !
!! V94
assign (resid 93 and name c ) (resid 94 and name n )
(resid 94 and name ca) (resid 94 and name c ) 1.0 -120.0 40.0 2
!! T95
assign (resid 94 and name c ) (resid 95 and name n )
(resid 95 and name ca) (resid 95 and name c ) 1.0 -120.0 40.0 2
!! V96
assign (resid 95 and name c ) (resid 96 and name n )
(resid 96 and name ca) (resid 96 and name c ) 1.0 -120.0 40.0 2
!! L100
assign (resid 99 and name c ) (resid 100 and name n )
(resid 100 and name ca) (resid 100 and name c ) 1.0 -120.0 40.0 2
!! chi1 torsion constraints
!! S8
assign (resid 8 and name n ) (resid 8 and name ca )
(resid 8 and name cb ) (resid 8 and name og ) 1.0 -60.0 30.0 2
!! C10
!assign (resid 10 and name n ) (resid 10 and name ca )
! (resid 10 and name cb ) (resid 10 and name sg ) 1.0 -60.0 50.0 2 !
!! Y12
assign (resid 12 and name n ) (resid 12 and name ca )
(resid 12 and name cb ) (resid 12 and name cg ) 1.0 60.0 30.0 2
!! S13
assign (resid 13 and name n ) (resid 13 and name ca )
(resid 13 and name cb ) (resid 13 and name og ) 1.0 60.0 30.0 2
!! R21
assign (resid 21 and name n ) (resid 21 and name ca )
(resid 21 and name cb ) (resid 21 and name cg ) 1.0 60.0 30.0 2
!! D28
assign (resid 28 and name n ) (resid 28 and name ca )
(resid 28 and name cb ) (resid 28 and name cg ) 1.0 -60.0 30.0 2
!! D35
assign (resid 35 and name n ) (resid 35 and name ca )
(resid 35 and name cb ) (resid 35 and name cg ) 1.0 -60.0 30.0 2
!! F46
assign (resid 46 and name n ) (resid 46 and name ca )
(resid 46 and name cb ) (resid 46 and name cg ) 1.0 60.0 30.0 2
!! N48
assign (resid 48 and name n ) (resid 48 and name ca )
(resid 48 and name cb ) (resid 48 and name cg ) 1.0 180.0 50.0 2 !
!! L54
assign (resid 54 and name n ) (resid 54 and name ca )
(resid 54 and name cb ) (resid 54 and name cg ) 1.0 60.0 50.0 2 !
!! R55
assign (resid 55 and name n ) (resid 55 and name ca )
(resid 55 and name cb ) (resid 55 and name cg ) 1.0 -60.0 30.0 2
!! Y70
assign (resid 70 and name n ) (resid 70 and name ca )
(resid 70 and name cb ) (resid 70 and name cg ) 1.0 -60.0 30.0 2
!! Q71
assign (resid 71 and name n ) (resid 71 and name ca )
(resid 71 and name cb ) (resid 71 and name cg ) 1.0 -60.0 30.0 2
!! Y72
assign (resid 72 and name n ) (resid 72 and name ca )
(resid 72 and name cb ) (resid 72 and name cg ) 1.0 60.0 30.0 2
!! L84
assign (resid 84 and name n ) (resid 84 and name ca )
(resid 84 and name cb ) (resid 84 and name cg ) 1.0 60.0 30.0 2
!! R85
assign (resid 85 and name n ) (resid 85 and name ca )
(resid 85 and name cb ) (resid 85 and name cg ) 1.0 60.0 30.0 2
!! D99
assign (resid 99 and name n ) (resid 99 and name ca )
(resid 99 and name cb ) (resid 99 and name cg ) 1.0 180.0 50.0 2 !
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